IID

P49640_Q96RI1.1 contacts (residues)

Receptor	R: Secondary Structure	R: Residue	R; Chain	R: Residue number	Ligand	L: Secondary Structure	L: Residue	L: Chain	L: Residue Number
R	-	MET	A	1	L	-	MET	V	1
R	-	MET	A	1	L	-	GLU	V	2
R	-	MET	A	1	L	-	SER	V	3
R	-	MET	A	101	L	-	CYS	V	47
R	-	PRO	A	102	L	-	GLY	V	46
R	-	PRO	A	102	L	-	CYS	V	47
R	-	ALA	A	103	L	-	CYS	V	47
R	H	THR	A	166	L	-	PRO	V	223
R	-	LYS	A	167	L	-	PRO	V	223
R	-	ASN	A	168	L	H	ALA	V	217
R	-	ASN	A	168	L	-	LEU	V	222
R	-	ASN	A	168	L	-	PRO	V	223
R	-	ASN	A	168	L	H	GLU	V	224
R	-	CYS	A	20	L	-	GLY	V	75
R	H	GLU	A	205	L	H	ARG	V	210
R	-	TYR	A	208	L	H	ARG	V	210
R	-	TYR	A	208	L	H	GLU	V	224
R	-	TYR	A	208	L	H	THR	V	225
R	-	THR	A	21	L	-	LEU	V	73
R	-	THR	A	21	L	-	ALA	V	74
R	-	PRO	A	22	L	-	LEU	V	73
R	-	SER	A	23	L	-	GLY	V	72
R	-	SER	A	23	L	-	LEU	V	73
R	-	GLY	A	24	L	-	ASP	V	71
R	-	GLY	A	24	L	-	GLY	V	72
R	-	GLY	A	24	L	-	LEU	V	73
R	-	PHE	A	25	L	-	LEU	V	73
R	-	PHE	A	26	L	-	VAL	V	70
R	H	GLU	A	328	L	-	MET	V	1
R	H	GLU	A	328	L	-	GLU	V	2
R	H	LYS	A	335	L	-	GLU	V	2
R	-	GLN	A	410	L	-	GLU	V	205
R	-	GLN	A	410	L	-	ASN	V	206
R	-	GLN	A	410	L	-	TYR	V	207
R	-	TYR	A	411	L	-	LYS	V	5
R	H	ARG	A	415	L	-	TYR	V	207
R	H	THR	A	452	L	H	ARG	V	210
R	H	THR	A	452	L	H	PRO	V	211
R	H	ARG	A	455	L	-	SER	V	209
R	H	ARG	A	455	L	H	PRO	V	211
R	H	THR	A	456	L	H	PRO	V	211
R	H	HIS	A	459	L	H	ARG	V	204
R	H	HIS	A	459	L	-	GLU	V	205
R	H	HIS	A	459	L	-	SER	V	209
R	H	HIS	A	459	L	H	ARG	V	212
R	-	GLN	A	486	L	-	ASP	V	6
R	-	TYR	A	76	L	-	MET	V	245
R	-	TYR	A	77	L	H	ALA	V	244
R	-	TYR	A	77	L	-	MET	V	245
R	-	SER	A	78	L	H	GLN	V	241
R	-	SER	A	78	L	H	ALA	V	244
R	-	SER	A	78	L	-	MET	V	245
R	-	SER	A	78	L	-	HIS	V	249
R	-	ASN	A	79	L	H	GLN	V	241
R	-	ASN	A	79	L	H	ALA	V	244
R	-	LEU	A	80	L	H	LYS	V	237
R	-	LEU	A	80	L	H	GLN	V	241
R	-	GLY	A	81	L	H	LYS	V	237
R	-	PHE	A	82	L	H	LYS	V	237
R	-	TYR	A	83	L	-	PHE	V	190
R	-	TYR	A	83	L	H	ARG	V	192
R	-	TYR	A	83	L	H	ILE	V	195
R	-	PRO	A	84	L	H	ARG	V	192
R	-	PRO	A	84	L	H	GLU	V	193
R	-	PRO	A	84	L	H	ILE	V	195
R	-	PRO	A	84	L	H	ALA	V	196
R	-	GLN	A	85	L	H	ARG	V	192
R	-	GLN	A	85	L	H	ALA	V	196
R	-	GLN	A	86	L	H	ARG	V	192
R	-	GLN	A	86	L	H	GLU	V	193
R	-	GLN	A	86	L	H	ALA	V	196
R	-	GLU	A	88	L	H	ARG	V	197
R	-	GLU	A	89	L	H	ARG	V	197
R	-	TYR	A	91	L	H	GLU	V	215
R	-	TYR	A	91	L	H	ALA	V	219

- Title of columns started by 'R:' means Receptor, 'L:' means Ligand
- In the Secondary Structure columns: 'H' means that residues in that row are part of Alpha Helix; 'S' - Beta Sheet

P49640_Q96RI1.1 contacts (residues & atoms)

Receptor	R: Secondary Structure	R: Atom	R: Residue	R; Chain	R: Residue number	Ligand	L: Secondary Structure	L; Atom	L: Residue	L: Chain	L: Residue Number
R	-	N	MET	A	1	L	-	N	MET	V	1
R	-	N	MET	A	1	L	-	H1	MET	V	1
R	-	N	MET	A	1	L	-	N	GLU	V	2
R	-	N	MET	A	1	L	-	CA	GLU	V	2
R	-	N	MET	A	1	L	-	C	GLU	V	2
R	-	N	MET	A	1	L	-	O	GLU	V	2
R	-	N	MET	A	1	L	-	H	GLU	V	2
R	-	N	MET	A	1	L	-	HB3	GLU	V	2
R	-	N	MET	A	1	L	-	HB2	SER	V	3
R	-	CA	MET	A	1	L	-	H	GLU	V	2
R	-	CA	MET	A	1	L	-	HB2	SER	V	3
R	-	CB	MET	A	1	L	-	O	GLU	V	2
R	-	CB	MET	A	1	L	-	HB2	SER	V	3
R	-	O	MET	A	1	L	-	H1	MET	V	1
R	-	CE	MET	A	1	L	-	OG	SER	V	3
R	-	CE	MET	A	1	L	-	HG	SER	V	3
R	-	CB	CYS	A	20	L	-	O	GLY	V	75
R	-	CB	CYS	A	20	L	-	H	GLY	V	75
R	-	SG	CYS	A	20	L	-	O	GLY	V	75
R	-	SG	CYS	A	20	L	-	H	GLY	V	75
R	-	C	THR	A	21	L	-	O	LEU	V	73
R	-	O	THR	A	21	L	-	O	LEU	V	73
R	-	O	THR	A	21	L	-	O	ALA	V	74
R	-	CA	PRO	A	22	L	-	O	LEU	V	73
R	-	CA	PRO	A	22	L	-	H	LEU	V	73
R	-	C	PRO	A	22	L	-	O	LEU	V	73
R	-	N	SER	A	23	L	-	N	LEU	V	73
R	-	N	SER	A	23	L	-	C	LEU	V	73
R	-	N	SER	A	23	L	-	CB	LEU	V	73
R	-	N	SER	A	23	L	-	O	LEU	V	73
R	-	N	SER	A	23	L	-	H	LEU	V	73
R	-	N	SER	A	23	L	-	HB2	LEU	V	73
R	-	CA	SER	A	23	L	-	HB2	LEU	V	73
R	-	C	SER	A	23	L	-	C	GLY	V	72
R	-	C	SER	A	23	L	-	O	GLY	V	72
R	-	C	SER	A	23	L	-	N	LEU	V	73
R	-	C	SER	A	23	L	-	CA	LEU	V	73
R	-	C	SER	A	23	L	-	CB	LEU	V	73
R	-	C	SER	A	23	L	-	CG	LEU	V	73
R	-	C	SER	A	23	L	-	CD1	LEU	V	73
R	-	C	SER	A	23	L	-	H	LEU	V	73
R	-	C	SER	A	23	L	-	HB2	LEU	V	73
R	-	C	SER	A	23	L	-	HB3	LEU	V	73
R	-	C	SER	A	23	L	-	HD11	LEU	V	73
R	-	C	SER	A	23	L	-	HD12	LEU	V	73
R	-	CB	SER	A	23	L	-	HB2	LEU	V	73
R	-	O	SER	A	23	L	-	C	GLY	V	72
R	-	O	SER	A	23	L	-	O	GLY	V	72
R	-	O	SER	A	23	L	-	N	LEU	V	73
R	-	O	SER	A	23	L	-	CA	LEU	V	73
R	-	O	SER	A	23	L	-	CB	LEU	V	73
R	-	O	SER	A	23	L	-	CG	LEU	V	73
R	-	O	SER	A	23	L	-	CD1	LEU	V	73
R	-	O	SER	A	23	L	-	H	LEU	V	73
R	-	O	SER	A	23	L	-	HB2	LEU	V	73
R	-	O	SER	A	23	L	-	HB3	LEU	V	73
R	-	O	SER	A	23	L	-	HG	LEU	V	73
R	-	O	SER	A	23	L	-	HD11	LEU	V	73
R	-	O	SER	A	23	L	-	HD12	LEU	V	73
R	-	O	SER	A	23	L	-	HD13	LEU	V	73
R	-	OG	SER	A	23	L	-	CB	LEU	V	73
R	-	OG	SER	A	23	L	-	HB2	LEU	V	73
R	-	OG	SER	A	23	L	-	HB3	LEU	V	73
R	-	N	GLY	A	24	L	-	O	ASP	V	71
R	-	N	GLY	A	24	L	-	C	GLY	V	72
R	-	N	GLY	A	24	L	-	O	GLY	V	72
R	-	N	GLY	A	24	L	-	CD1	LEU	V	73
R	-	N	GLY	A	24	L	-	HB2	LEU	V	73
R	-	N	GLY	A	24	L	-	HD11	LEU	V	73
R	-	CA	GLY	A	24	L	-	O	ASP	V	71
R	-	CA	GLY	A	24	L	-	O	GLY	V	72
R	-	CA	GLY	A	24	L	-	CD1	LEU	V	73
R	-	CA	GLY	A	24	L	-	HB2	LEU	V	73
R	-	CA	GLY	A	24	L	-	HD11	LEU	V	73
R	-	CA	GLY	A	24	L	-	HD12	LEU	V	73
R	-	C	GLY	A	24	L	-	O	ASP	V	71
R	-	C	GLY	A	24	L	-	O	GLY	V	72
R	-	C	GLY	A	24	L	-	CD1	LEU	V	73
R	-	C	GLY	A	24	L	-	HD11	LEU	V	73
R	-	C	GLY	A	24	L	-	HD12	LEU	V	73
R	-	C	GLY	A	24	L	-	HD13	LEU	V	73
R	-	O	GLY	A	24	L	-	O	ASP	V	71
R	-	O	GLY	A	24	L	-	C	GLY	V	72
R	-	O	GLY	A	24	L	-	O	GLY	V	72
R	-	O	GLY	A	24	L	-	CB	LEU	V	73
R	-	O	GLY	A	24	L	-	CG	LEU	V	73
R	-	O	GLY	A	24	L	-	CD1	LEU	V	73
R	-	O	GLY	A	24	L	-	HB2	LEU	V	73
R	-	O	GLY	A	24	L	-	HG	LEU	V	73
R	-	O	GLY	A	24	L	-	HD11	LEU	V	73
R	-	O	GLY	A	24	L	-	HD12	LEU	V	73
R	-	O	GLY	A	24	L	-	HD13	LEU	V	73
R	-	N	PHE	A	25	L	-	HD11	LEU	V	73
R	-	CB	PHE	A	25	L	-	HD13	LEU	V	73
R	-	CD2	PHE	A	26	L	-	HG21	VAL	V	70
R	-	CA	TYR	A	76	L	-	HA	MET	V	245
R	-	C	TYR	A	76	L	-	CA	MET	V	245
R	-	C	TYR	A	76	L	-	HA	MET	V	245
R	-	C	TYR	A	76	L	-	HB3	MET	V	245
R	-	C	TYR	A	76	L	-	HG2	MET	V	245
R	-	CB	TYR	A	76	L	-	O	MET	V	245
R	-	CB	TYR	A	76	L	-	HA	MET	V	245
R	-	O	TYR	A	76	L	-	CA	MET	V	245
R	-	O	TYR	A	76	L	-	C	MET	V	245
R	-	O	TYR	A	76	L	-	CB	MET	V	245
R	-	O	TYR	A	76	L	-	O	MET	V	245
R	-	O	TYR	A	76	L	-	CG	MET	V	245
R	-	O	TYR	A	76	L	-	HA	MET	V	245
R	-	O	TYR	A	76	L	-	HB3	MET	V	245
R	-	O	TYR	A	76	L	-	HG2	MET	V	245
R	-	O	TYR	A	76	L	-	HG3	MET	V	245
R	-	N	TYR	A	77	L	-	HA	MET	V	245
R	-	CA	TYR	A	77	L	-	HA	MET	V	245
R	-	C	TYR	A	77	L	H	C	ALA	V	244
R	-	C	TYR	A	77	L	H	O	ALA	V	244
R	-	C	TYR	A	77	L	H	HB1	ALA	V	244
R	-	C	TYR	A	77	L	-	HA	MET	V	245
R	-	O	TYR	A	77	L	H	C	ALA	V	244
R	-	O	TYR	A	77	L	H	O	ALA	V	244
R	-	O	TYR	A	77	L	H	HB1	ALA	V	244
R	-	O	TYR	A	77	L	-	N	MET	V	245
R	-	O	TYR	A	77	L	-	CA	MET	V	245
R	-	O	TYR	A	77	L	-	HA	MET	V	245
R	-	N	SER	A	78	L	H	C	ALA	V	244
R	-	N	SER	A	78	L	H	CB	ALA	V	244
R	-	N	SER	A	78	L	H	O	ALA	V	244
R	-	N	SER	A	78	L	H	HB1	ALA	V	244
R	-	N	SER	A	78	L	H	HB3	ALA	V	244
R	-	N	SER	A	78	L	-	HA	MET	V	245
R	-	CA	SER	A	78	L	H	HB1	ALA	V	244
R	-	C	SER	A	78	L	H	CB	ALA	V	244
R	-	C	SER	A	78	L	H	HB1	ALA	V	244
R	-	C	SER	A	78	L	H	HB3	ALA	V	244
R	-	CB	SER	A	78	L	H	HB1	ALA	V	244
R	-	CB	SER	A	78	L	-	CD2	HIS	V	249
R	-	CB	SER	A	78	L	-	HD2	HIS	V	249
R	-	O	SER	A	78	L	H	HA	GLN	V	241
R	-	O	SER	A	78	L	H	CA	ALA	V	244
R	-	O	SER	A	78	L	H	CB	ALA	V	244
R	-	O	SER	A	78	L	H	HB1	ALA	V	244
R	-	O	SER	A	78	L	H	HB2	ALA	V	244
R	-	O	SER	A	78	L	H	HB3	ALA	V	244
R	-	OG	SER	A	78	L	-	HD2	HIS	V	249
R	-	N	ASN	A	79	L	H	HB1	ALA	V	244
R	-	C	ASN	A	79	L	H	HE21	GLN	V	241
R	-	N	LEU	A	80	L	H	HE21	GLN	V	241
R	-	C	LEU	A	80	L	H	CE	LYS	V	237
R	-	C	LEU	A	80	L	H	HE3	LYS	V	237
R	-	C	LEU	A	80	L	H	HZ1	LYS	V	237
R	-	O	LEU	A	80	L	H	CE	LYS	V	237
R	-	O	LEU	A	80	L	H	HE3	LYS	V	237
R	-	O	LEU	A	80	L	H	HZ1	LYS	V	237
R	-	N	GLY	A	81	L	H	CE	LYS	V	237
R	-	N	GLY	A	81	L	H	NZ	LYS	V	237
R	-	N	GLY	A	81	L	H	HE2	LYS	V	237
R	-	N	GLY	A	81	L	H	HE3	LYS	V	237
R	-	N	GLY	A	81	L	H	HZ1	LYS	V	237
R	-	N	GLY	A	81	L	H	HZ2	LYS	V	237
R	-	N	GLY	A	81	L	H	HZ3	LYS	V	237
R	-	CA	GLY	A	81	L	H	CE	LYS	V	237
R	-	CA	GLY	A	81	L	H	NZ	LYS	V	237
R	-	CA	GLY	A	81	L	H	HE2	LYS	V	237
R	-	CA	GLY	A	81	L	H	HE3	LYS	V	237
R	-	CA	GLY	A	81	L	H	HZ1	LYS	V	237
R	-	CA	GLY	A	81	L	H	HZ2	LYS	V	237
R	-	CA	GLY	A	81	L	H	HZ3	LYS	V	237
R	-	C	GLY	A	81	L	H	NZ	LYS	V	237
R	-	C	GLY	A	81	L	H	HZ1	LYS	V	237
R	-	C	GLY	A	81	L	H	HZ2	LYS	V	237
R	-	C	GLY	A	81	L	H	HZ3	LYS	V	237
R	-	O	GLY	A	81	L	H	CE	LYS	V	237
R	-	O	GLY	A	81	L	H	NZ	LYS	V	237
R	-	O	GLY	A	81	L	H	HZ1	LYS	V	237
R	-	O	GLY	A	81	L	H	HZ2	LYS	V	237
R	-	O	GLY	A	81	L	H	HZ3	LYS	V	237
R	-	N	PHE	A	82	L	H	HZ1	LYS	V	237
R	-	N	PHE	A	82	L	H	HZ3	LYS	V	237
R	-	N	TYR	A	83	L	H	HG23	ILE	V	195
R	-	CA	TYR	A	83	L	H	HG23	ILE	V	195
R	-	CA	TYR	A	83	L	H	HD12	ILE	V	195
R	-	CA	TYR	A	83	L	H	HD13	ILE	V	195
R	-	C	TYR	A	83	L	H	HG2	ARG	V	192
R	-	C	TYR	A	83	L	H	HD3	ARG	V	192
R	-	C	TYR	A	83	L	H	HG23	ILE	V	195
R	-	CB	TYR	A	83	L	H	CG1	ILE	V	195
R	-	CB	TYR	A	83	L	H	CG2	ILE	V	195
R	-	CB	TYR	A	83	L	H	CD1	ILE	V	195
R	-	CB	TYR	A	83	L	H	HB	ILE	V	195
R	-	CB	TYR	A	83	L	H	HG23	ILE	V	195
R	-	CB	TYR	A	83	L	H	HD11	ILE	V	195
R	-	CB	TYR	A	83	L	H	HD12	ILE	V	195
R	-	CB	TYR	A	83	L	H	HD13	ILE	V	195
R	-	O	TYR	A	83	L	H	HG2	ARG	V	192
R	-	O	TYR	A	83	L	H	CG2	ILE	V	195
R	-	O	TYR	A	83	L	H	HG21	ILE	V	195
R	-	O	TYR	A	83	L	H	HG23	ILE	V	195
R	-	CG	TYR	A	83	L	H	CD1	ILE	V	195
R	-	CG	TYR	A	83	L	H	HD11	ILE	V	195
R	-	CG	TYR	A	83	L	H	HD12	ILE	V	195
R	-	CG	TYR	A	83	L	H	HD13	ILE	V	195
R	-	CD1	TYR	A	83	L	-	O	PHE	V	190
R	-	CD1	TYR	A	83	L	H	CA	ARG	V	192
R	-	CD1	TYR	A	83	L	H	HA	ARG	V	192
R	-	CD1	TYR	A	83	L	H	HB2	ARG	V	192
R	-	CD1	TYR	A	83	L	H	CD1	ILE	V	195
R	-	CD1	TYR	A	83	L	H	HD11	ILE	V	195
R	-	CD1	TYR	A	83	L	H	HD12	ILE	V	195
R	-	CD1	TYR	A	83	L	H	HD13	ILE	V	195
R	-	CD2	TYR	A	83	L	H	HD11	ILE	V	195
R	-	CD2	TYR	A	83	L	H	HD12	ILE	V	195
R	-	CD2	TYR	A	83	L	H	HD13	ILE	V	195
R	-	CE1	TYR	A	83	L	-	O	PHE	V	190
R	-	CE1	TYR	A	83	L	H	HA	ARG	V	192
R	-	CE1	TYR	A	83	L	H	HB2	ARG	V	192
R	-	CE1	TYR	A	83	L	H	HD13	ILE	V	195
R	-	N	PRO	A	84	L	H	CB	ARG	V	192
R	-	N	PRO	A	84	L	H	CG	ARG	V	192
R	-	N	PRO	A	84	L	H	CD	ARG	V	192
R	-	N	PRO	A	84	L	H	HA	ARG	V	192
R	-	N	PRO	A	84	L	H	HB2	ARG	V	192
R	-	N	PRO	A	84	L	H	HG2	ARG	V	192
R	-	N	PRO	A	84	L	H	HG3	ARG	V	192
R	-	N	PRO	A	84	L	H	HD2	ARG	V	192
R	-	N	PRO	A	84	L	H	HD3	ARG	V	192
R	-	CA	PRO	A	84	L	H	CG	ARG	V	192
R	-	CA	PRO	A	84	L	H	CD	ARG	V	192
R	-	CA	PRO	A	84	L	H	NE	ARG	V	192
R	-	CA	PRO	A	84	L	H	HG2	ARG	V	192
R	-	CA	PRO	A	84	L	H	HG3	ARG	V	192
R	-	CA	PRO	A	84	L	H	HD2	ARG	V	192
R	-	CA	PRO	A	84	L	H	HD3	ARG	V	192
R	-	CA	PRO	A	84	L	H	HH11	ARG	V	192
R	-	C	PRO	A	84	L	H	CB	ARG	V	192
R	-	C	PRO	A	84	L	H	O	ARG	V	192
R	-	C	PRO	A	84	L	H	CG	ARG	V	192
R	-	C	PRO	A	84	L	H	CD	ARG	V	192
R	-	C	PRO	A	84	L	H	NE	ARG	V	192
R	-	C	PRO	A	84	L	H	HA	ARG	V	192
R	-	C	PRO	A	84	L	H	HG2	ARG	V	192
R	-	C	PRO	A	84	L	H	HG3	ARG	V	192
R	-	C	PRO	A	84	L	H	HD2	ARG	V	192
R	-	C	PRO	A	84	L	H	HD3	ARG	V	192
R	-	C	PRO	A	84	L	H	HH11	ARG	V	192
R	-	C	PRO	A	84	L	H	HB2	ALA	V	196
R	-	CB	PRO	A	84	L	H	CG	ARG	V	192
R	-	CB	PRO	A	84	L	H	CD	ARG	V	192
R	-	CB	PRO	A	84	L	H	NE	ARG	V	192
R	-	CB	PRO	A	84	L	H	NH1	ARG	V	192
R	-	CB	PRO	A	84	L	H	CZ	ARG	V	192
R	-	CB	PRO	A	84	L	H	HG2	ARG	V	192
R	-	CB	PRO	A	84	L	H	HG3	ARG	V	192
R	-	CB	PRO	A	84	L	H	HD2	ARG	V	192
R	-	CB	PRO	A	84	L	H	HD3	ARG	V	192
R	-	CB	PRO	A	84	L	H	HE	ARG	V	192
R	-	CB	PRO	A	84	L	H	HH11	ARG	V	192
R	-	CB	PRO	A	84	L	H	HH12	ARG	V	192
R	-	O	PRO	A	84	L	H	CA	ARG	V	192
R	-	O	PRO	A	84	L	H	C	ARG	V	192
R	-	O	PRO	A	84	L	H	CB	ARG	V	192
R	-	O	PRO	A	84	L	H	O	ARG	V	192
R	-	O	PRO	A	84	L	H	CG	ARG	V	192
R	-	O	PRO	A	84	L	H	CD	ARG	V	192
R	-	O	PRO	A	84	L	H	NE	ARG	V	192
R	-	O	PRO	A	84	L	H	HA	ARG	V	192
R	-	O	PRO	A	84	L	H	HB2	ARG	V	192
R	-	O	PRO	A	84	L	H	HB3	ARG	V	192
R	-	O	PRO	A	84	L	H	HG2	ARG	V	192
R	-	O	PRO	A	84	L	H	HG3	ARG	V	192
R	-	O	PRO	A	84	L	H	HD2	ARG	V	192
R	-	O	PRO	A	84	L	H	HD3	ARG	V	192
R	-	O	PRO	A	84	L	H	HE	ARG	V	192
R	-	O	PRO	A	84	L	H	N	GLU	V	193
R	-	O	PRO	A	84	L	H	HB	ILE	V	195
R	-	O	PRO	A	84	L	H	HB2	ALA	V	196
R	-	CG	PRO	A	84	L	H	CB	ARG	V	192
R	-	CG	PRO	A	84	L	H	CG	ARG	V	192
R	-	CG	PRO	A	84	L	H	CD	ARG	V	192
R	-	CG	PRO	A	84	L	H	NE	ARG	V	192
R	-	CG	PRO	A	84	L	H	NH1	ARG	V	192
R	-	CG	PRO	A	84	L	H	CZ	ARG	V	192
R	-	CG	PRO	A	84	L	H	HB2	ARG	V	192
R	-	CG	PRO	A	84	L	H	HG2	ARG	V	192
R	-	CG	PRO	A	84	L	H	HG3	ARG	V	192
R	-	CG	PRO	A	84	L	H	HD2	ARG	V	192
R	-	CG	PRO	A	84	L	H	HD3	ARG	V	192
R	-	CG	PRO	A	84	L	H	HE	ARG	V	192
R	-	CG	PRO	A	84	L	H	HH11	ARG	V	192
R	-	CG	PRO	A	84	L	H	HH12	ARG	V	192
R	-	CD	PRO	A	84	L	H	CB	ARG	V	192
R	-	CD	PRO	A	84	L	H	CG	ARG	V	192
R	-	CD	PRO	A	84	L	H	CD	ARG	V	192
R	-	CD	PRO	A	84	L	H	NE	ARG	V	192
R	-	CD	PRO	A	84	L	H	HA	ARG	V	192
R	-	CD	PRO	A	84	L	H	HB2	ARG	V	192
R	-	CD	PRO	A	84	L	H	HG2	ARG	V	192
R	-	CD	PRO	A	84	L	H	HG3	ARG	V	192
R	-	CD	PRO	A	84	L	H	HD2	ARG	V	192
R	-	CD	PRO	A	84	L	H	HD3	ARG	V	192
R	-	CD	PRO	A	84	L	H	HH11	ARG	V	192
R	-	N	GLN	A	85	L	H	CG	ARG	V	192
R	-	N	GLN	A	85	L	H	CD	ARG	V	192
R	-	N	GLN	A	85	L	H	HG2	ARG	V	192
R	-	N	GLN	A	85	L	H	HG3	ARG	V	192
R	-	N	GLN	A	85	L	H	HD2	ARG	V	192
R	-	N	GLN	A	85	L	H	HB2	ALA	V	196
R	-	CA	GLN	A	85	L	H	CG	ARG	V	192
R	-	CA	GLN	A	85	L	H	HG2	ARG	V	192
R	-	CA	GLN	A	85	L	H	HG3	ARG	V	192
R	-	CA	GLN	A	85	L	H	HD2	ARG	V	192
R	-	CA	GLN	A	85	L	H	CB	ALA	V	196
R	-	CA	GLN	A	85	L	H	HB1	ALA	V	196
R	-	CA	GLN	A	85	L	H	HB2	ALA	V	196
R	-	CA	GLN	A	85	L	H	HB3	ALA	V	196
R	-	C	GLN	A	85	L	H	CG	ARG	V	192
R	-	C	GLN	A	85	L	H	CD	ARG	V	192
R	-	C	GLN	A	85	L	H	HG2	ARG	V	192
R	-	C	GLN	A	85	L	H	HG3	ARG	V	192
R	-	C	GLN	A	85	L	H	HD2	ARG	V	192
R	-	C	GLN	A	85	L	H	HB2	ALA	V	196
R	-	CB	GLN	A	85	L	H	HB1	ALA	V	196
R	-	CB	GLN	A	85	L	H	HB2	ALA	V	196
R	-	O	GLN	A	85	L	H	CG	ARG	V	192
R	-	O	GLN	A	85	L	H	CD	ARG	V	192
R	-	O	GLN	A	85	L	H	NE	ARG	V	192
R	-	O	GLN	A	85	L	H	CZ	ARG	V	192
R	-	O	GLN	A	85	L	H	HG3	ARG	V	192
R	-	O	GLN	A	85	L	H	HD2	ARG	V	192
R	-	O	GLN	A	85	L	H	HE	ARG	V	192
R	-	CG	GLN	A	85	L	H	HB1	ALA	V	196
R	-	CG	GLN	A	85	L	H	HB2	ALA	V	196
R	-	N	GLN	A	86	L	H	HG3	ARG	V	192
R	-	N	GLN	A	86	L	H	CA	GLU	V	193
R	-	N	GLN	A	86	L	H	HA	GLU	V	193
R	-	N	GLN	A	86	L	H	HB2	ALA	V	196
R	-	N	GLN	A	86	L	H	HB3	ALA	V	196
R	-	CA	GLN	A	86	L	H	HA	GLU	V	193
R	-	CA	GLN	A	86	L	H	HB2	GLU	V	193
R	-	CA	GLN	A	86	L	H	HG3	GLU	V	193
R	-	C	GLN	A	86	L	H	HA	GLU	V	193
R	-	C	GLN	A	86	L	H	HG3	GLU	V	193
R	-	CB	GLN	A	86	L	H	CB	GLU	V	193
R	-	CB	GLN	A	86	L	H	HA	GLU	V	193
R	-	CB	GLN	A	86	L	H	HB2	GLU	V	193
R	-	CB	GLN	A	86	L	H	HG3	GLU	V	193
R	-	O	GLN	A	86	L	H	CG	GLU	V	193
R	-	O	GLN	A	86	L	H	HA	GLU	V	193
R	-	O	GLN	A	86	L	H	HB2	GLU	V	193
R	-	O	GLN	A	86	L	H	HG2	GLU	V	193
R	-	O	GLN	A	86	L	H	HG3	GLU	V	193
R	-	O	GLN	A	86	L	H	HB3	ALA	V	196
R	-	CG	GLN	A	86	L	H	HB3	ARG	V	192
R	-	CG	GLN	A	86	L	H	HE	ARG	V	192
R	-	CG	GLN	A	86	L	H	HB2	GLU	V	193
R	-	C	GLU	A	88	L	H	NH2	ARG	V	197
R	-	C	GLU	A	88	L	H	HH21	ARG	V	197
R	-	C	GLU	A	88	L	H	HH22	ARG	V	197
R	-	O	GLU	A	88	L	H	NH2	ARG	V	197
R	-	O	GLU	A	88	L	H	CZ	ARG	V	197
R	-	O	GLU	A	88	L	H	HH21	ARG	V	197
R	-	O	GLU	A	88	L	H	HH22	ARG	V	197
R	-	N	GLU	A	89	L	H	HH21	ARG	V	197
R	-	CE2	TYR	A	91	L	H	HB2	ALA	V	219
R	-	OH	TYR	A	91	L	H	HB3	GLU	V	215
R	-	OH	TYR	A	91	L	H	HG2	GLU	V	215
R	-	OH	TYR	A	91	L	H	HB2	ALA	V	219
R	-	O	MET	A	101	L	-	SG	CYS	V	47
R	-	O	MET	A	101	L	-	HG	CYS	V	47
R	-	O	PRO	A	102	L	-	HA3	GLY	V	46
R	-	O	PRO	A	102	L	-	HG	CYS	V	47
R	-	CB	ALA	A	103	L	-	HG	CYS	V	47
R	H	O	THR	A	166	L	-	HB3	PRO	V	223
R	-	C	LYS	A	167	L	-	HB3	PRO	V	223
R	-	N	ASN	A	168	L	-	HB3	PRO	V	223
R	-	CB	ASN	A	168	L	-	HA	PRO	V	223
R	-	CB	ASN	A	168	L	-	HB3	PRO	V	223
R	-	CG	ASN	A	168	L	H	HB1	ALA	V	217
R	-	CG	ASN	A	168	L	-	CA	PRO	V	223
R	-	CG	ASN	A	168	L	-	CB	PRO	V	223
R	-	CG	ASN	A	168	L	-	HA	PRO	V	223
R	-	CG	ASN	A	168	L	-	HB3	PRO	V	223
R	-	CG	ASN	A	168	L	H	N	GLU	V	224
R	-	CG	ASN	A	168	L	H	H	GLU	V	224
R	-	CG	ASN	A	168	L	H	HG3	GLU	V	224
R	-	ND2	ASN	A	168	L	H	HB1	ALA	V	217
R	-	ND2	ASN	A	168	L	-	C	LEU	V	222
R	-	ND2	ASN	A	168	L	-	O	LEU	V	222
R	-	ND2	ASN	A	168	L	-	N	PRO	V	223
R	-	ND2	ASN	A	168	L	-	CA	PRO	V	223
R	-	ND2	ASN	A	168	L	-	C	PRO	V	223
R	-	ND2	ASN	A	168	L	-	CB	PRO	V	223
R	-	ND2	ASN	A	168	L	-	HA	PRO	V	223
R	-	ND2	ASN	A	168	L	-	HB2	PRO	V	223
R	-	ND2	ASN	A	168	L	-	HB3	PRO	V	223
R	-	ND2	ASN	A	168	L	H	N	GLU	V	224
R	-	ND2	ASN	A	168	L	H	H	GLU	V	224
R	-	ND2	ASN	A	168	L	H	HG3	GLU	V	224
R	-	OD1	ASN	A	168	L	-	HA	PRO	V	223
R	-	OD1	ASN	A	168	L	H	H	GLU	V	224
R	-	OD1	ASN	A	168	L	H	HG3	GLU	V	224
R	H	OE1	GLU	A	205	L	H	HG2	ARG	V	210
R	H	OE1	GLU	A	205	L	H	HE	ARG	V	210
R	-	CG	TYR	A	208	L	H	HH12	ARG	V	210
R	-	CD1	TYR	A	208	L	H	HB	THR	V	225
R	-	CD2	TYR	A	208	L	H	HH12	ARG	V	210
R	-	CD2	TYR	A	208	L	H	HH22	ARG	V	210
R	-	CE1	TYR	A	208	L	H	HB3	GLU	V	224
R	-	CE1	TYR	A	208	L	H	N	THR	V	225
R	-	CE1	TYR	A	208	L	H	CA	THR	V	225
R	-	CE1	TYR	A	208	L	H	CB	THR	V	225
R	-	CE1	TYR	A	208	L	H	H	THR	V	225
R	-	CE1	TYR	A	208	L	H	HA	THR	V	225
R	-	CE1	TYR	A	208	L	H	HB	THR	V	225
R	-	CE2	TYR	A	208	L	H	HH12	ARG	V	210
R	-	CE2	TYR	A	208	L	H	HH22	ARG	V	210
R	-	CE2	TYR	A	208	L	H	HB3	GLU	V	224
R	-	OH	TYR	A	208	L	H	CB	GLU	V	224
R	-	OH	TYR	A	208	L	H	H	GLU	V	224
R	-	OH	TYR	A	208	L	H	HB3	GLU	V	224
R	-	OH	TYR	A	208	L	H	H	THR	V	225
R	-	OH	TYR	A	208	L	H	HB	THR	V	225
R	-	CZ	TYR	A	208	L	H	HH12	ARG	V	210
R	-	CZ	TYR	A	208	L	H	HB3	GLU	V	224
R	-	CZ	TYR	A	208	L	H	H	THR	V	225
R	-	CZ	TYR	A	208	L	H	HB	THR	V	225
R	H	CD	GLU	A	328	L	-	HB2	MET	V	1
R	H	OE1	GLU	A	328	L	-	HB2	MET	V	1
R	H	OE1	GLU	A	328	L	-	H3	MET	V	1
R	H	OE2	GLU	A	328	L	-	CB	MET	V	1
R	H	OE2	GLU	A	328	L	-	HB2	MET	V	1
R	H	OE2	GLU	A	328	L	-	HB3	MET	V	1
R	H	OE2	GLU	A	328	L	-	H3	MET	V	1
R	H	OE2	GLU	A	328	L	-	OE2	GLU	V	2
R	H	CE	LYS	A	335	L	-	HG2	GLU	V	2
R	H	NZ	LYS	A	335	L	-	HG2	GLU	V	2
R	-	CG	GLN	A	410	L	-	CD2	TYR	V	207
R	-	CG	GLN	A	410	L	-	HB2	TYR	V	207
R	-	CG	GLN	A	410	L	-	HD2	TYR	V	207
R	-	CD	GLN	A	410	L	-	HB2	TYR	V	207
R	-	CD	GLN	A	410	L	-	HD2	TYR	V	207
R	-	NE2	GLN	A	410	L	-	HB2	GLU	V	205
R	-	NE2	GLN	A	410	L	-	HG2	GLU	V	205
R	-	NE2	GLN	A	410	L	-	H	ASN	V	206
R	-	NE2	GLN	A	410	L	-	CB	TYR	V	207
R	-	NE2	GLN	A	410	L	-	H	TYR	V	207
R	-	NE2	GLN	A	410	L	-	HB2	TYR	V	207
R	-	NE2	GLN	A	410	L	-	HD2	TYR	V	207
R	-	OH	TYR	A	411	L	-	NZ	LYS	V	5
R	-	OH	TYR	A	411	L	-	HZ1	LYS	V	5
R	-	OH	TYR	A	411	L	-	HZ2	LYS	V	5
R	-	CZ	TYR	A	411	L	-	HZ1	LYS	V	5
R	H	NH1	ARG	A	415	L	-	HH	TYR	V	207
R	H	NH2	ARG	A	415	L	-	OH	TYR	V	207
R	H	NH2	ARG	A	415	L	-	HE1	TYR	V	207
R	H	NH2	ARG	A	415	L	-	HH	TYR	V	207
R	H	CZ	ARG	A	415	L	-	HH	TYR	V	207
R	H	O	THR	A	452	L	H	HD2	PRO	V	211
R	H	CG2	THR	A	452	L	H	CB	ARG	V	210
R	H	CG2	THR	A	452	L	H	CG	ARG	V	210
R	H	CG2	THR	A	452	L	H	HB2	ARG	V	210
R	H	CG2	THR	A	452	L	H	HB3	ARG	V	210
R	H	CG2	THR	A	452	L	H	HG2	ARG	V	210
R	H	CG2	THR	A	452	L	H	HG3	ARG	V	210
R	H	C	ARG	A	455	L	-	HB2	SER	V	209
R	H	C	ARG	A	455	L	H	HG3	PRO	V	211
R	H	CB	ARG	A	455	L	-	HB2	SER	V	209
R	H	O	ARG	A	455	L	-	HB2	SER	V	209
R	H	O	ARG	A	455	L	-	HG	SER	V	209
R	H	N	THR	A	456	L	H	CG	PRO	V	211
R	H	N	THR	A	456	L	H	HG3	PRO	V	211
R	H	N	THR	A	456	L	H	HD2	PRO	V	211
R	H	CA	THR	A	456	L	H	CG	PRO	V	211
R	H	CA	THR	A	456	L	H	HG2	PRO	V	211
R	H	CA	THR	A	456	L	H	HG3	PRO	V	211
R	H	C	THR	A	456	L	H	HG3	PRO	V	211
R	H	CB	THR	A	456	L	H	CB	PRO	V	211
R	H	CB	THR	A	456	L	H	CG	PRO	V	211
R	H	CB	THR	A	456	L	H	HB2	PRO	V	211
R	H	CB	THR	A	456	L	H	HG2	PRO	V	211
R	H	CB	THR	A	456	L	H	HG3	PRO	V	211
R	H	CB	THR	A	456	L	H	HD2	PRO	V	211
R	H	CG2	THR	A	456	L	H	CB	PRO	V	211
R	H	CG2	THR	A	456	L	H	CG	PRO	V	211
R	H	CG2	THR	A	456	L	H	HB2	PRO	V	211
R	H	CG2	THR	A	456	L	H	HB3	PRO	V	211
R	H	CG2	THR	A	456	L	H	HG2	PRO	V	211
R	H	CG2	THR	A	456	L	H	HG3	PRO	V	211
R	H	OG1	THR	A	456	L	H	CB	PRO	V	211
R	H	OG1	THR	A	456	L	H	CG	PRO	V	211
R	H	OG1	THR	A	456	L	H	CD	PRO	V	211
R	H	OG1	THR	A	456	L	H	HB2	PRO	V	211
R	H	OG1	THR	A	456	L	H	HB3	PRO	V	211
R	H	OG1	THR	A	456	L	H	HG2	PRO	V	211
R	H	OG1	THR	A	456	L	H	HG3	PRO	V	211
R	H	OG1	THR	A	456	L	H	HD2	PRO	V	211
R	H	OG1	THR	A	456	L	H	HD3	PRO	V	211
R	H	CB	HIS	A	459	L	-	HG	SER	V	209
R	H	CG	HIS	A	459	L	-	HG	SER	V	209
R	H	CG	HIS	A	459	L	H	HB3	ARG	V	212
R	H	CD2	HIS	A	459	L	H	HH21	ARG	V	204
R	H	CD2	HIS	A	459	L	H	HH22	ARG	V	204
R	H	CD2	HIS	A	459	L	-	HG	SER	V	209
R	H	CD2	HIS	A	459	L	H	CB	ARG	V	212
R	H	CD2	HIS	A	459	L	H	HB3	ARG	V	212
R	H	CD2	HIS	A	459	L	H	HD3	ARG	V	212
R	H	ND1	HIS	A	459	L	H	NH2	ARG	V	204
R	H	ND1	HIS	A	459	L	H	HH21	ARG	V	204
R	H	ND1	HIS	A	459	L	H	HH22	ARG	V	204
R	H	ND1	HIS	A	459	L	-	CD	GLU	V	205
R	H	ND1	HIS	A	459	L	-	OE1	GLU	V	205
R	H	ND1	HIS	A	459	L	-	OE2	GLU	V	205
R	H	CE1	HIS	A	459	L	H	NE	ARG	V	204
R	H	CE1	HIS	A	459	L	H	NH2	ARG	V	204
R	H	CE1	HIS	A	459	L	H	CZ	ARG	V	204
R	H	CE1	HIS	A	459	L	H	HE	ARG	V	204
R	H	CE1	HIS	A	459	L	H	HH21	ARG	V	204
R	H	CE1	HIS	A	459	L	H	HH22	ARG	V	204
R	H	CE1	HIS	A	459	L	-	CD	GLU	V	205
R	H	CE1	HIS	A	459	L	-	OE1	GLU	V	205
R	H	CE1	HIS	A	459	L	H	HB3	ARG	V	212
R	H	CE1	HIS	A	459	L	H	HG3	ARG	V	212
R	H	CE1	HIS	A	459	L	H	HD3	ARG	V	212
R	H	NE2	HIS	A	459	L	H	NH2	ARG	V	204
R	H	NE2	HIS	A	459	L	H	CZ	ARG	V	204
R	H	NE2	HIS	A	459	L	H	HH21	ARG	V	204
R	H	NE2	HIS	A	459	L	H	HH22	ARG	V	204
R	H	NE2	HIS	A	459	L	H	CB	ARG	V	212
R	H	NE2	HIS	A	459	L	H	CG	ARG	V	212
R	H	NE2	HIS	A	459	L	H	CD	ARG	V	212
R	H	NE2	HIS	A	459	L	H	HB3	ARG	V	212
R	H	NE2	HIS	A	459	L	H	HG3	ARG	V	212
R	H	NE2	HIS	A	459	L	H	HD3	ARG	V	212
R	-	C	GLN	A	486	L	-	OD1	ASP	V	6
R	-	CB	GLN	A	486	L	-	OD2	ASP	V	6
R	-	O	GLN	A	486	L	-	CG	ASP	V	6
R	-	O	GLN	A	486	L	-	OD1	ASP	V	6

- Title of columns started by 'R:' means Receptor, 'L:' means Ligand
- In the Secondary Structure columns: 'H' means that residues/atoms in that row are part of Alpha Helix; 'S' - Beta Sheet

Krembil, Jurisica Lab. July 16, 2025 Database: 1.0.4.1